Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 2/20 | 0.62 |
| ▸ | IRAK4 | Q9NWZ3 | 4/20 | 0.58 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.55 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.55 |
| ▸ | CTSA | P10619 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.52 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28438775 | 0.86 | GRM5 (0.64) | GRM5P2RX7NPC1RAB9AKMT2A | |
| SCHEMBL20303115 | 0.83 | KMT2A (0.50) | GRM5NPC1RAB9AKMT2ACTSA | |
| SCHEMBL21595579 | 0.83 | SMN1; SMN2 (0.63) | GRM5P2RX7NPC1RAB9AKMT2A | |
| SCHEMBL30763254 | 0.83 | SMN1; SMN2 (0.63) | GRM5P2RX7NPC1RAB9AKMT2A | |
| SCHEMBL28492426 | 0.83 | GRM5 (0.60) | GRM5P2RX7NPC1RAB9AKMT2A | |
| SCHEMBL12090707 | 0.82 | GRM5 (0.59) | GRM5P2RX7NPC1RAB9AKMT2A | |
| SCHEMBL29643946 | 0.82 | GRM5 (0.59) | GRM5P2RX7NPC1RAB9AKMT2A | |
| SCHEMBL30761113 | 0.79 | POLB (0.77) | GRM5P2RX7NPC1RAB9AKMT2A | |
| SCHEMBL13201029 | 0.79 | POLB (0.77) | GRM5P2RX7NPC1RAB9AKMT2A | |
| Ammonia Solution, Strong SCHEMBL20303236 | 0.78 | MCL1 (0.56) | IRAK4NPC1RAB9AKMT2ACYP1A2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018118868-A1 | TRIAZOLE DERIVATIVES AS TANKYRASE INHIBITORS | OSLO UNIVERSITY HOSPITAL HF (NO) | 2018-06-28 | — | — | WO | disclosed |
| EP-1858854-A1 | PYRIDINE-2-CARBOXAMIDE DERIVATIVES AS MGLUR5 ANTAGONISTS | F. Hoffmann-La Roche AG (CH) | 2007-11-28 | — | — | EP | disclosed |
| WO-2006094639-A1 | PYRIDINE-2-CARBOXAMIDE DERIVATIVES AS MGLUR5 ANTAGONISTS | F.HOFFMANN-LA ROCHE AG (CH) | 2006-09-14 | — | — | WO | disclosed |